SCHEMBL9605558

SCHEMBL9605558

Cc1cccc(NC(=O)c2cccc3c2CCN(Cc2ccncc2)C3)c1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDR P35968 8/20 0.53
CARM1 Q86X55 1/20 0.51
POLB P06746 1/20 0.51
KDM4E B2RXH2 2/20 0.50
ALDH1A1 P00352 1/20 0.50
MAPT P10636 1/20 0.50
RAB9A P51151 1/20 0.50
SMN1; SMN2 Q16637 3/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
LMNA P02545 2/20 0.48
USP2 O75604 1/20 0.48
TSHR P16473 1/20 0.48
NOD1 Q9Y239 1/20 0.48
BRD4 O60885 1/20 0.47
EP300 Q09472 1/20 0.47
CREBBP Q92793 1/20 0.47
ACACB O00763 1/20 0.46

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL14147238 0.89 KDR (0.53) KDRCARM1KDM4EMAPTSMN1; SMN2
SCHEMBL14122641 0.89 CARM1 (0.60) KDRCARM1KDM4ERAB9ASMN1; SMN2
SCHEMBL9605554 0.88 KDR (0.55) KDRCARM1KDM4EMAPTRAB9A
SCHEMBL4982048 0.85 KDR (0.61) KDRCARM1KDM4ERAB9ASMN1; SMN2
SCHEMBL9605522 0.85 KDR (0.55) KDRCARM1KDM4EALDH1A1MEN1
SCHEMBL14134955 0.85 NOD1 (0.53) KDRCARM1KDM4ERAB9ASMN1; SMN2
SCHEMBL9605547 0.84 KDR (0.70) KDRCARM1KDM4EALDH1A1MAPT
SCHEMBL9605955 0.82 KDR (0.78) KDRCARM1POLBKDM4EALDH1A1
SCHEMBL4443192 0.79 P2RY1 (0.50) KDRKDM4EALDH1A1MEN1KMT2A
SCHEMBL9605898 0.79 PTPN1 (0.49) KDM4EALDH1A1MAPTSMN1; SMN2MEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8338455-B2 Pyridines or pyrimidines having 4-(hydrogenated 1-pyridyl- or hydrogenated 1-isoquinolyl rings, e.g., N-(4-chlorophenyl)-2-(pyridin-4-ylmethyl)-1,2,3,4-tetrahydroisoquinoline-5-carboxamide; kinase inhibitors; inflammation, angiogenesis and cancer AMGEN INC. (US) 2012-12-25 US disclosed
US-8338455-B2 Pyridines or pyrimidines having 4-(hydrogenated 1-pyridyl- or hydrogenated 1-isoquinolyl rings, e.g., N-(4-chlorophenyl)-2-(pyridin-4-ylmethyl)-1,2,3,4-tetrahydroisoquinoline-5-carboxamide; kinase inhibitors; inflammation, angiogenesis and cancer AMGEN INC. (US) 2012-12-25 US disclosed
EP-2118088-B1 Heterocyclic compounds and their use in treating inflammation, angiogenesis and cancer AMGEN INC (US) 2012-05-30 EP disclosed
US-20080161346-A1 Compounds and methods of use AMGEN INC. (US) 2008-07-03 US disclosed
US-20080161346-A1 Compounds and methods of use AMGEN INC. (US) 2008-07-03 US disclosed
WO-2008079292-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE IN TREATING INFLAMMATION, ANGIOGENESIS AND CANCER AMGEN INC. (US) 2008-07-03 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080161346-A1 Compounds and methods of use VHL, VEGFA, FLT1 KDR 6/4885CARM1 3322/4885POLB 425/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.